SCHEMBL31483754

SCHEMBL31483754

COC(=O)c1ccc2c(=O)[nH]c(CCl)nc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.72
RECQL P46063 1/20 0.72
ALDH1A1 P00352 3/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
HTT P42858 2/20 0.62
RAB9A P51151 2/20 0.62
HSD17B10 Q99714 3/20 0.57
MAPT P10636 2/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
POLB P06746 1/20 0.56
PARP1 P09874 3/20 0.49
PDE5A O76074 1/20 0.48
TNKS O95271 1/20 0.48
CSNK2A1 P68400 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46
USP2 O75604 1/20 0.45
NPC1 O15118 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2118620 1.00 KDM4E (0.72) KDM4ERECQLALDH1A1SMN1; SMN2HTT
SCHEMBL10262840 0.87 KDM4E (0.62) KDM4ERECQLALDH1A1SMN1; SMN2HTT
SCHEMBL2039522 0.85 KDM4E (0.60) KDM4ERECQLALDH1A1SMN1; SMN2HTT
SCHEMBL2118708 0.83 ALDH1A1 (0.58) KDM4ERECQLALDH1A1SMN1; SMN2HTT
SCHEMBL6093891 0.83 SMN1; SMN2 (0.57) KDM4ERECQLALDH1A1SMN1; SMN2HTT
SCHEMBL402452 0.82 PDE5A (0.57) KDM4ERECQLALDH1A1SMN1; SMN2HTT
SCHEMBL2118255 0.81 KDM4E (0.57) KDM4EALDH1A1SMN1; SMN2HTTRAB9A
SCHEMBL37938 0.81 PDE5A (0.77) KDM4ERECQLALDH1A1SMN1; SMN2HTT
SCHEMBL24329791 0.80 ALDH1A1 (0.60) KDM4EALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL2117452 0.80 KDM4E (0.54) KDM4ERECQLALDH1A1SMN1; SMN2HTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111699176-B Quinazolinones as PARP14 inhibitors 里邦医疗公司 2025-02-14 CN disclosed